AV18424

921623-31-6 | 4-(4,4,4-Trifluorobutoxy)benzoic acid

Manufacturer: A2B Chem

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CatalogNumber

AV18424

ChemicalName

4-(4,4,4-Trifluorobutoxy)benzoic acid

CasNumber

921623-31-6

MolecularFormula

C11H11F3O3

MolecularWeight

248.1984

MdlNumber

MFCD25710955

Smiles

OC(=O)c1ccc(cc1)OCCCC(F)(F)F

Complexity

245

Covalently-bondedUnitCount

1

HeavyAtomCount

17

HydrogenBondAcceptorCount

6

HydrogenBondDonorCount

1

RotatableBondCount

5

Xlogp3

4.1

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A2B Chem

AV18424

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CatalogNumber:
AV18424

ChemicalName:
4-(4,4,4-Trifluorobutoxy)benzoic acid

CasNumber:
921623-31-6

MolecularFormula:
C11H11F3O3

MolecularWeight:
248.1984

MdlNumber:
MFCD25710955

Smiles:
OC(=O)c1ccc(cc1)OCCCC(F)(F)F

Complexity:
245

Covalently-bondedUnitCount:
1

HeavyAtomCount:
17

HydrogenBondAcceptorCount:
6

HydrogenBondDonorCount:
1

RotatableBondCount:
5

Xlogp3:
4.1

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A2B Chem

AV18425

--


CatalogNumber:
AV18425

ChemicalName:
2-(6-(3-Chlorophenyl)pyridin-2-yl)acetonitrile

CasNumber:
1824263-95-7

MolecularFormula:
C13H9ClN2

MolecularWeight:
228.677

MdlNumber:
MFCD20038551

Smiles:
N#CCc1cccc(n1)c1cccc(c1)Cl

Complexity:
270

Covalently-bondedUnitCount:
1

HeavyAtomCount:
16

HydrogenBondAcceptorCount:
2

HydrogenBondDonorCount:
__

RotatableBondCount:
2

Xlogp3:
2.8

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A2B Chem

AV18426

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
O=C(OC(C)(C)C)N[C@@H]1[C@H]2CC[C@@H]([C@H]1C(=O)O)C2

Complexity:
361

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
2.4

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A2B Chem

AV18427

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CatalogNumber:
AV18427

ChemicalName:
2-(2,6-Dichloro-3-fluorophenyl)ethanol

CasNumber:
1571065-36-5

MolecularFormula:
C8H7Cl2FO

MolecularWeight:
209.045

MdlNumber:
MFCD29917028

Smiles:
OCCc1c(Cl)ccc(c1Cl)F

Complexity:
145

Covalently-bondedUnitCount:
1

HeavyAtomCount:
12

HydrogenBondAcceptorCount:
2

HydrogenBondDonorCount:
1

RotatableBondCount:
2

Xlogp3:
2.9